9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0334 |
| Compound Name: | 9-(3-methylphenyl)-8-oxo-2-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 435.44 |
| Molecular Formula: | C22 H21 N5 O5 |
| Smiles: | Cc1cccc(c1)N1C(Nc2c(C(N)=O)nc(c3cc(c(c(c3)OC)OC)OC)nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9276 |
| logD: | 2.9202 |
| logSw: | -3.2386 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.588 |
| InChI Key: | QCXPCNAUANMGRD-UHFFFAOYSA-N |